SCHEMBL18821567

SCHEMBL18821567

CCC(C)NC(CCCCN)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 1/20 0.39
▸ SIRT1 Q96EB6 1/20 0.39
▸ FOLH1 Q04609 1/20 0.38
▸ HPGDS O60760 1/20 0.36
▸ GNAI3 P08754 1/20 0.36
▸ GNAO1 P09471 1/20 0.36
▸ GNAI1 P63096 1/20 0.36
▸ GSR P00390 1/20 0.36
▸ SLC6A5 Q9Y345 1/20 0.36
▸ CPB2 Q96IY4 2/20 0.35
▸ CA1 P00915 2/20 0.35
▸ RNPEP Q9H4A4 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ TLR2 O60603 1/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ DPP8 Q6V1X1 1/20 0.34
▸ DPP9 Q86TI2 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19386702 0.88 SIRT6 (0.38) SIRT6SIRT1FOLH1GNAI3GNAO1
SCHEMBL13707922 0.84 FOLH1 (0.41) SIRT6SIRT1FOLH1HPGDSGNAI3
SCHEMBL18457874 0.83 GSR (0.40) SIRT6SIRT1FOLH1HPGDSGNAI3
SCHEMBL23330464 0.78 FOLH1 (0.35) SIRT6SIRT1FOLH1HPGDSGSR
SCHEMBL25944730 0.77 CASP2 (0.49) SIRT6SIRT1SLC6A5TLR2DPP7
SCHEMBL2248012 0.77 GABRP (0.44) FOLH1HPGDSGSRCA1CA12
SCHEMBL15834023 0.77 FOLH1 (0.45) SIRT6SIRT1FOLH1HPGDSGNAI3
SCHEMBL2547160 0.76 ANPEP (0.51) CPB2TLR2
SCHEMBL13416824 0.76 FOLH1 (0.43) SIRT6SIRT1FOLH1HPGDSGNAI3
SCHEMBL1262904 0.76 FOLH1 (0.43) SIRT6SIRT1FOLH1HPGDSGNAI3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170119907-A1 Targeted Therapeutics MEDIVATION TECHNOLOGIES, INC. (US) 2017-05-04 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170119907-A1 Targeted Therapeutics ANXA3, ANXA5, ANXA6 SIRT6 2958/4885SIRT1 4333/4885FOLH1 219/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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